H2Y
Summary
| Name: | 2-(4-methoxyphenyl)-N-(pyridin-3-yl)acetamide |
| Formula: | C14 H14 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 242.273 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(4-methoxyphenyl)-N-(pyridin-3-yl)acetamide |
| OpenEye OEToolkits | 2.0.6 | 2-(4-methoxyphenyl)-~{N}-pyridin-3-yl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(Cc1ccc(OC)cc1)=O)c2cnccc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H14N2O2/c1-18-13-6-4-11(5-7-13)9-14(17)16-12-3-2-8-15-10-12/h2-8,10H,9H2,1H3,(H,16,17) |
| InChIKey | InChI | 1.03 | MQUBBMQYRRRRDN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(CC(=O)Nc2cccnc2)cc1 |
| SMILES | CACTVS | 3.385 | COc1ccc(CC(=O)Nc2cccnc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1)CC(=O)Nc2cccnc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1)CC(=O)Nc2cccnc2 |
